SCHEMBL4070752

SCHEMBL4070752

CC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.61
NPC1 O15118 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.53
LMNA P02545 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
UCHL1 P09936 2/20 0.49
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SCN4A P35499 1/20 0.45
EPHX2 P34913 1/20 0.45
USP30 Q70CQ3 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5469907 1.00 HSD17B10 (0.61) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL5423413 1.00 HSD17B10 (0.61) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL13804206 0.95 HSD17B10 (0.56) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL12427648 0.95 HSD17B10 (0.56) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL13804123 0.95 HSD17B10 (0.56) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL31048407 0.93 HSD17B10 (0.55) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL7286305 0.90 HSD17B10 (0.61) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL19414808 0.90 HSD17B10 (0.61) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL895773 0.90 HSD17B10 (0.61) HSD17B10NPC1SMN1; SMN2LMNANPSR1
SCHEMBL14000638 0.89 HSD17B10 (0.49) HSD17B10NPC1SMN1; SMN2LMNANPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313553-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER BOEHRINGER INGELHEIM INTL GMBH CORP (DE) 2025-10-09 US disclosed
US-20250136582-A1 SELECT KRAS G12C INHIBITORS AND USES THEREOF 1200 PHARMA LLC (US) 2025-05-01 US disclosed
CN-119156383-A Selective KRAS G12C inhibitors and uses thereof 1200药业有限责任公司 2024-12-17 CN disclosed
CN-119013272-A Cyclic 2-amino-3-cyanothiophenes and derivatives thereof for the treatment of cancer 勃林格殷格翰国际有限公司 2024-11-22 CN disclosed
EP-4441050-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER Boehringer Ingelheim International GmbH (DE) 2024-10-09 EP disclosed
US-20240228511-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS ELI LILLY AND COMPANY 2024-07-11 US disclosed
CN-112812128-B Macrocyclic compounds as ALK and ROS modulators 正大天晴药业集团股份有限公司 2024-04-02 CN disclosed
US-20240101553-A1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-03-28 US disclosed
CN-111925360-B 1-heterocyclylisochromanyl compounds and analogs for the treatment of CNS disorders 赛诺维信制药公司 2024-03-22 CN disclosed
US-20240059677-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AS NICOTINIC ACETYLCHOLINESTERASE RECEPTOR ALPHA 6 MODULATOR CEREVANCE LTD (GB) 2024-02-22 US disclosed
US-7358378-B2 Processes for the preparation of paclitaxel FLORIDA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2008-04-15 US disclosed
US-20080051407-A1 These compounds lack a 1,4-bridging group as found in the ecteinascidins; and, have at the C-1 position a substituent selected from an amino or hydroxy group, optionally protected or derivatized; anticarcinogenic agents PHARMA MAR, S.A., A MADRID SPAIN CORPORATION 2008-02-28 US disclosed
US-20070276017-A1 Thiadiazoline Derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2007-11-29 US disclosed
US-7173024-B2 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use ORION CORPORATION (FI) 2007-02-06 US disclosed
WO-2006127550-A1 PROLINE BIS-AMIDE OREXIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2006-11-30 WO disclosed
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 US disclosed
US-20050020677-A1 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use ORION CORPORATION (FI) 2005-01-27 US disclosed
EP-1401810-A1 COMPOUNDS HAVING PROLYL OLIGOPEPTIDASE INHIBITORY ACTIVITY, METHODS FOR THEIR PREPARATION AND THEIR USE ORION CORPORATION (FI) 2004-03-31 EP disclosed
WO-2003004468-A1 COMPOUNDS HAVING PROLYL OLIGOPEPTIDASE INHIBITORY ACTIVITY, METHODS FOR THEIR PREPARATION AND THEIR USE ORION CORPORATION (FI) 2003-01-16 WO disclosed
CN-1348442-A Novel sulfonamide compounds and uses thereof MERCK & CO INC (US) 2002-05-08 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250136582-A1 SELECT KRAS G12C INHIBITORS AND USES THEREOF KRAS, NRAS, HRAS HSD17B10 3478/4885NPC1 1597/4885SMN1; SMN2 1670/4885
US-20250313553-A1 ANNULATED 2-AMINO-3-CYANO THIOPHENES AND DERIVATIVES FOR THE TREATMENT OF CANCER KRAS, NRAS, TP53 HSD17B10 4874/4885NPC1 3943/4885SMN1; SMN2 3654/4885
US-20240059677-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AS NICOTINIC ACETYLCHOLINESTERASE RECEPTOR ALPHA 6 MODULATOR CHRNA6, CHRM2, CHRNA1 HSD17B10 2585/4885NPC1 2248/4885SMN1; SMN2 1414/4885
US-20070276017-A1 Thiadiazoline Derivative BRD7, NR3C2, NR5A2 HSD17B10 903/4885NPC1 3452/4885SMN1; SMN2 4003/4885
US-20050020677-A1 Compounds having prolyl oligopeptidase inhibitory activity, methods for their preparation and their use DNPEP, PREP, ANPEP HSD17B10 1513/4885NPC1 754/4885SMN1; SMN2 2511/4885
US-20240228511-A1 SUBSTITUTED FUSED AZINES AS KRAS G12D INHIBITORS KRAS, NRAS, TP53 HSD17B10 4403/4885NPC1 2826/4885SMN1; SMN2 3062/4885
US-20080051407-A1 These compounds lack a 1,4-bridging group as found in the ecteinascidins; and, have at the C-1 position a substituent selected from an amino or hydroxy group, optionally protected or derivatized; anticarcinogenic agents FN1, RCN1, ERCC4 HSD17B10 1242/4885NPC1 4435/4885SMN1; SMN2 3230/4885
US-20240101553-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS HSD17B10 3889/4885NPC1 1409/4885SMN1; SMN2 4385/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.